Geometry & MOs

Info

ID:	407063
PubChem CID:	135079227
Reduced:	NSO3C6H10 (2)
Stoich.:	ABC3D6E10 (2)
Weight, g/mol:	261.24565
ΔH_f, kcal/mol:	-271.4
Dipole, Da:	3.56
IP(EA), eV:	-9.34(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohexyl-2,6-dimethyl-N-prop-2-enylhepta-1,6-dien-4-amine

Drug info:

PubChemData

Smile

COC(=O)CNC(=O)CCSSCCC(=O)NCC(=O)OC

DOS

IR

Vibrations